TITLE CHF3, MP2/6-31G* geometry PWFTOL 0.000000000001 ANGSTROM ATOMS C 6 .000000 .000000 .341023 LIBRARY CscG2ae END H 1 .000000 .000000 1.429485 LIBRARY HscG2ae END F 9 .000000 1.258200 -.128727 LIBRARY FscG2ae END F 9 1.089633 -.629100 -.128727 LIBRARY FscG2ae END F 9 -1.089633 -.629100 -.128727 LIBRARY FscG2ae END END MULTIPLICITY 1 DFT KOHNSHAM EM LEBEDEV VFOCK OFF MOBASIS OFF functional QUAD 1 END START FINISH